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	hartrees
Energy at 0K	-170.148130
Energy at 298.15K	-170.154823
HF Energy	-170.148130
Nuclear repulsion energy	83.208757

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	4158	3784	42.66
2	A	3807	3464	3.57
3	A	3723	3389	1.76
4	A	3248	2956	43.64
5	A	3176	2890	74.13
6	A	1802	1640	32.22
7	A	1644	1496	0.23
8	A	1552	1412	50.96
9	A	1504	1369	0.03
10	A	1488	1354	13.26
11	A	1247	1135	47.96
12	A	1182	1076	66.52
13	A	1136	1034	221.25
14	A	983	895	2.76
15	A	903	822	146.53
16	A	521	474	45.67
17	A	399	364	95.24
18	A	292	265	81.66

Atom	x (Å)	y (Å)	z (Å)
N1	1.212	-0.158	-0.017
C2	-0.039	0.533	0.047
O3	-1.180	-0.265	-0.114
H4	1.292	-0.685	-0.861
H5	1.344	-0.776	0.755
H6	-0.083	1.069	0.988
H7	-0.080	1.254	-0.756
H8	-1.283	-0.839	0.624

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4304	2.3966	0.9981	0.9981	2.0478	2.0511	2.6645
C2	1.4304		1.4022	2.0197	2.0321	1.0842	1.0794	1.9400
O3	2.3966	1.4022		2.6165	2.7182	2.0491	1.9826	0.9403
H4	0.9981	2.0197	2.6165		1.6186	2.8961	2.3777	2.9762
H5	0.9981	2.0321	2.7182	1.6186		2.3449	2.9038	2.6311
H6	2.0478	1.0842	2.0491	2.8961	2.3449		1.7537	2.2831
H7	2.0511	1.0794	1.9826	2.3777	2.9038	1.7537		2.7805
H8	2.6645	1.9400	0.9403	2.9762	2.6311	2.2831	2.7805

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	115.574	N1	C2	H6	108.262
N1	C2	H7	108.811	C2	N1	H4	111.299
C2	N1	H5	112.382	C2	O3	H8	110.267
O3	C2	H6	110.341	O3	C2	H7	105.316
H4	N1	H5	108.362	H6	C2	H7	108.299

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: HF/cc-pVTZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	N	-0.375
2	C	0.143
3	O	-0.400
4	H	0.147
5	H	0.134
6	H	0.063
7	H	0.089
8	H	0.199

	x	y	z	Total
	0.290	-1.070	1.278	1.692
CHELPG
AIM
ESP

	x	y	z
x	3.703	-0.065	-0.060
y	-0.065	3.543	-0.113
z	-0.060	-0.113	3.485

<r²>	48.731
(<r²>)^1/2	6.981

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: HF/cc-pVTZ

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)